In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2010 | 30 | No |
Popular Name: [2-[2-[4-[[(5S)-2,4-dioxothiazolidin-5-yl]methyl]phenoxy]ethyl-methyl-amino]-4-pyridyl] [2-[2-[4-[[(5S)-2,4-dioxothiazol…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | -0.59 | 3.82 | -50.24 | 2 | 10 | 0 | 139 | 453.498 | 9 | ↓ |
Hi High (pH 8-9.5) | -0.59 | 3.51 | -51.64 | 1 | 10 | -1 | 138 | 452.49 | 9 | ↓ |